CID 6477881

Carbon monoxide; [(e)-2-(dimethylamino)-7-(4-nitrophenyl)hept-6-enyl]chromium

Structural Information

Molecular Formula
C15H18N2O2
SMILES
C[C]([CH][CH][CH]/C=C/C1=CC=C(C=C1)[N+](=O)[O-])N(C)C
InChI
InChI=1S/C15H18N2O2/c1-13(16(2)3)7-5-4-6-8-14-9-11-15(12-10-14)17(18)19/h4-12H,1-3H3/b5-4?,8-6+,13-7?
InChIKey
VEZXLOQGFWKTRO-SECQZYGGSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.13684 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.144116 164.0
[M+Na]+ 281.126058 168.0
[M-H]- 257.129564 168.2
[M+NH4]+ 276.170663 180.3
[M+K]+ 297.099998 162.1
[M+H-H2O]+ 241.134100 161.3
[M+HCOO]- 303.135041 188.4
[M+CH3COO]- 317.150691 199.2
[M+Na-2H]- 279.111506 167.3
[M]+ 258.13629142 164.3
[M]- 258.13738858 164.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.