CID 137346510

[3-(hydroxymethyl)-3h-diazirin-3-yl]methanol

Structural Information

Molecular Formula
C3H6N2O2
SMILES
C(C1(N=N1)CO)O
InChI
InChI=1S/C3H6N2O2/c6-1-3(2-7)4-5-3/h6-7H,1-2H2
InChIKey
DDDYUEZXLYCRHD-UHFFFAOYSA-N
Compound name
[3-(hydroxymethyl)diazirin-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

102.04293 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.05021 121.7
[M+Na]+ 125.03215 134.1
[M+NH4]+ 120.07675 130.6
[M+K]+ 141.00609 129.6
[M-H]- 101.03565 127.4
[M+Na-2H]- 123.01760 130.6
[M]+ 102.04238 126.1
[M]- 102.04348 126.1
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.