CID 96180

Ethanol, 2-(salicylamino)-

Structural Information

Molecular Formula
C9H13NO2
SMILES
C1=CC=C(C(=C1)CNCCO)O
InChI
InChI=1S/C9H13NO2/c11-6-5-10-7-8-3-1-2-4-9(8)12/h1-4,10-12H,5-7H2
InChIKey
DDNZKESRAINYTI-UHFFFAOYSA-N
Compound name
2-[(2-hydroxyethylamino)methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

73
Patents

167.09464 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.10192 134.8
[M+Na]+ 190.08386 141.3
[M-H]- 166.08736 135.8
[M+NH4]+ 185.12846 153.8
[M+K]+ 206.05780 138.5
[M+H-H2O]+ 150.09190 129.2
[M+HCOO]- 212.09284 157.8
[M+CH3COO]- 226.10849 176.2
[M+Na-2H]- 188.06931 141.6
[M]+ 167.09409 133.4
[M]- 167.09519 133.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe