CID 6010275

3765-28-4

Structural Information

Molecular Formula

C₁₀H₁₆O₂

SMILES

CC1C(O1)(C)/C=C/C2C(O2)(C)C

InChI

InChI=1S/C10H16O2/c1-7-10(4,11-7)6-5-8-9(2,3)12-8/h5-8H,1-4H3/b6-5+

InChIKey

AJXYQJKBNYBUFD-AATRIKPKSA-N

Compound name

2-[(E)-2-(3,3-dimethyloxiran-2-yl)ethenyl]-2,3-dimethyloxirane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 16
Patents: 168.11504 Da
Monoisotopic Mass: 1.1
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]+	169.122316	146.5
[M+Na]+	191.104258	155.7
[M-H]-	167.107764	155.9
[M+NH4]+	186.148863	157.3
[M+K]+	207.078198	159.3
[M+H-H2O]+	151.112300	142.6
[M+HCOO]-	213.113241	163.4
[M+CH3COO]-	227.128891	193.1
[M+Na-2H]-	189.089706	152.7
[M]+	168.11449142	155.0
[M]-	168.11558858	155.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe