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]+ 259.14412 164.0
[M+Na]+ 281.12606 168.0
[M-H]- 257.12956 168.2
[M+NH4]+ 276.17066 180.3
[M+K]+ 297.10000 162.1
[M+H-H2O]+ 241.13410 161.3
[M+HCOO]- 303.13504 188.4
[M+CH3COO]- 317.15069 199.2
[M+Na-2H]- 279.11151 167.3
[M]+ 258.13629 164.3
[M]- 258.13739 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.