CID 101690107

2-(1,2-diamino-1-propenyl)phenol

Structural Information

Molecular Formula
C9H12N2O
SMILES
C/C(=C(\C1=CC=CC=C1O)/N)/N
InChI
InChI=1S/C9H12N2O/c1-6(10)9(11)7-4-2-3-5-8(7)12/h2-5,12H,10-11H2,1H3/b9-6-
InChIKey
OULZGBBYEVBHQQ-TWGQIWQCSA-N
Compound name
2-[(Z)-1,2-diaminoprop-1-enyl]phenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

164.09496 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.10224 136.2
[M+Na]+ 187.08418 145.7
[M+NH4]+ 182.12878 143.6
[M+K]+ 203.05812 141.4
[M-H]- 163.08768 138.0
[M+Na-2H]- 185.06963 141.1
[M]+ 164.09441 137.6
[M]- 164.09551 137.6
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.