CID 56828077

1955556-99-6

Structural Information

Molecular Formula

C₁₀H₁₈N₂O₂

SMILES

CC(C)(C)OC(=O)N1CC2(C1)CCN2

InChI

InChI=1S/C10H18N2O2/c1-9(2,3)14-8(13)12-6-10(7-12)4-5-11-10/h11H,4-7H2,1-3H3

InChIKey

WDVOLHDNUMLNAK-UHFFFAOYSA-N

Compound name

tert-butyl 1,6-diazaspiro[3.3]heptane-6-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 91
Patents: 198.13683 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]+	199.14411	145.0
[M+Na]+	221.12605	148.5
[M-H]-	197.12955	146.3
[M+NH4]+	216.17065	150.1
[M+K]+	237.09999	153.0
[M+H-H2O]+	181.13409	130.8
[M+HCOO]-	243.13503	157.4
[M+CH3COO]-	257.15068	192.8
[M+Na-2H]-	219.11150	149.4
[M]+	198.13628	159.3
[M]-	198.13738	159.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe