CID 135432048

Dtxsid2062743

Structural Information

Molecular Formula
C12H16N2O2
SMILES
CC1=C(C(=C(C(=C1C=NO)C)C)C=NO)C
InChI
InChI=1S/C12H16N2O2/c1-7-8(2)12(6-14-16)10(4)9(3)11(7)5-13-15/h5-6,15-16H,1-4H3
InChIKey
SFEKTPODPIECNA-UHFFFAOYSA-N
Compound name
N-[[4-(hydroxyiminomethyl)-2,3,5,6-tetramethylphenyl]methylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

0
Patents

220.12119 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.128466 148.5
[M+Na]+ 243.110408 158.2
[M-H]- 219.113914 153.4
[M+NH4]+ 238.155013 167.7
[M+K]+ 259.084348 155.5
[M+H-H2O]+ 203.118450 142.5
[M+HCOO]- 265.119391 174.9
[M+CH3COO]- 279.135041 197.3
[M+Na-2H]- 241.095856 152.2
[M]+ 220.12064142 151.2
[M]- 220.12173858 151.2
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.