CID 81573358

1501749-81-0

Structural Information

Molecular Formula

C₆H₁₃NO₂

SMILES

CC1(COCC1N)CO

InChI

InChI=1S/C6H13NO2/c1-6(3-8)4-9-2-5(6)7/h5,8H,2-4,7H2,1H3

InChIKey

PFVARNJSAKTDSL-UHFFFAOYSA-N

Compound name

(4-amino-3-methyloxolan-3-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 131.09464 Da
Monoisotopic Mass: -0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	132.10192	126.1
[M+Na]+	154.08386	134.6
[M+NH4]+	149.12846	135.5
[M+K]+	170.05780	130.7
[M-H]-	130.08736	128.1
[M+Na-2H]-	152.06931	130.5
[M]+	131.09409	127.7
[M]-	131.09519	127.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe