CID 145913274

Rac-(1'r,4'r)-dispiro[1,3-dioxolane-2,2'-bicyclo[2.2.1]heptane-5',2''-oxirane]

Structural Information

Molecular Formula

C₁₀H₁₄O₃

SMILES

C1COC2(O1)C[C@@H]3C[C@H]2CC34CO4

InChI

InChI=1S/C10H14O3/c1-2-12-10(11-1)5-7-3-8(10)4-9(7)6-13-9/h7-8H,1-6H2/t7-,8-,9?/m0/s1

InChIKey

DCPSXCZMQSGTAX-JVIMKECRSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 182.0943 Da
Monoisotopic Mass: 0.3
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]+	183.101576	135.5
[M+Na]+	205.083518	145.4
[M-H]-	181.087024	145.0
[M+NH4]+	200.128123	157.2
[M+K]+	221.057458	147.1
[M+H-H2O]+	165.091560	133.9
[M+HCOO]-	227.092501	151.5
[M+CH3COO]-	241.108151	149.7
[M+Na-2H]-	203.068966	142.5
[M]+	182.09375142	138.8
[M]-	182.09484858	138.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.