CID 147358189

2415383-17-2

Structural Information

Molecular Formula

C₇H₁₂O₂

SMILES

C1CC1[C@@H]2COC[C@H]2O

InChI

InChI=1S/C7H12O2/c8-7-4-9-3-6(7)5-1-2-5/h5-8H,1-4H2/t6-,7+/m0/s1

InChIKey

DGSMXHAIGYAGEK-NKWVEPMBSA-N

Compound name

(3S,4R)-4-cyclopropyloxolan-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 128.08372 Da
Monoisotopic Mass: 0.6
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]+	129.09100	122.7
[M+Na]+	151.07294	131.4
[M-H]-	127.07644	129.6
[M+NH4]+	146.11754	139.8
[M+K]+	167.04688	130.6
[M+H-H2O]+	111.08098	117.5
[M+HCOO]-	173.08192	143.9
[M+CH3COO]-	187.09757	171.0
[M+Na-2H]-	149.05839	128.4
[M]+	128.08317	123.1
[M]-	128.08427	123.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe